Files

14 total

Fe2O8Sr3Tl (P4/mmm) - doped C 5.0%

.cif file

Interstitially doped with C at ~5.0%; supercell [2, 2, 2]; dopant atoms = 6

3mo

1750229.cif

.cif file
3mo

1750229.cif - doped C 5.0%

.cif file

Interstitially doped with C at ~5.0%; supercell [2, 2, 2]; dopant atoms = 6

3mo

Fe2O8Sr3Tl (P4/mmm) - phonon dispersion 2

Image file

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -19.87 THz

3mo

Fe2O8Sr3Tl (P4/mmm) - phonon dispersion 1

Image file

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -19.87 THz

3mo

FeNiCo (P2/m) - phonon dispersion

Image file

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -3.84 THz

3mo

Fe2O8Sr3Tl (P4/mmm) - phonon dispersion

Image file

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -19.87 THz

3mo

C9H8NO2 (P1)

.cif file

C9H8NO2 (space group: P1 #1, crystal system: triclinic, point group: 1)

3mo

C19H22N4O4S (P1)

.cif file

C19H22N4O4S (space group: P1 #1, crystal system: triclinic, point group: 1)

3mo

Fe2O8Sr3Tl (P4/mmm)

.cif file

Fe2O8Sr3Tl (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)

3mo

FeNiCo (P2/m)

.cif file

FeNiCo (space group: P2/m #10, crystal system: monoclinic, point group: 2/m)

3mo

MgNiV (P-1)

.cif file

MgNiV (space group: P-1 #2, crystal system: triclinic, point group: -1)

3mo

Generated crystal structures for Fe-Co-Ni 1

.zip file

4 generated crystal structures for the chemical system Fe-Co-Ni

3mo

Generated crystal structures for Fe-Co-Ni

.zip file

16 generated crystal structures for the chemical system Fe-Co-Ni

3mo